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Histone H2B

Core component of nucleosome. Nucleosomes wrap and compact DNA into chromatin, limiting DNA accessibility to the cellular machineries which require DNA as a template. Histones thereby play a central role in transcription regulation, DNA repair, DNA replication and chromosomal stability. DNA accessibility is regulated via a complex set of post-translational modifications of histones, also called histone code, and nucleosome remodeling.

AlphaFold DB , UniProt , Accession A0A077ZIV3, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 123 aa.

						>A0A077ZIV3_TRITR|A0A077ZIV3
MAGKAVVKGVKKAGKTQKVTKGGDKKRRKSRKESFATYIYKVLKQVHPDTGISSKAMSIMNSFVNDVFDRIGAEASRLAHYNNRHTISSREIQTAVRLLLPGELSKHAVSEGTKAVTKYTSAK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	44.4	Very low	51.3	Low	247 Å²	247	149.4 Å²	149.4	100%	1.217	89%	0.888	S	S	*	*				0	112.5	0	-73.3	-93.9	-160	0	0	108.3
2	A	49.1	Very low	51	Low	109 Å²	109	153.8 Å²	153.8	90%	0.901	89%	0.888	S	S	*	*			trans	24.5	102.8	169.2	0	0	0	0	0	121.2
3	G	44.6	Very low	50.9	Low	82 Å²	82	150 Å²	150	85%	0.845	89%	0.886	S	S	*	*			trans	-89.2	142.7	153.9	0	0	0	0	0	111.5
4	K	52.7	Low	50.7	Low	209 Å²	209	144.6 Å²	144.6	91%	0.909	88%	0.877	S	S	*	*			trans	-113.2	103.7	170.3	-106	178.7	175	177	0	108.9
5	A	54.1	Low	50.7	Low	96 Å²	96	148.1 Å²	148.1	79%	0.793	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-85.6	128	167.9	0	0	0	0	0	109.4
6	V	59	Low	50.7	Low	145 Å²	145	147.8 Å²	147.8	88%	0.879	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-84.4	123	178.8	179.8	0	0	0	0	109.1
7	V	59.5	Low	51.1	Low	136 Å²	136	150.1 Å²	150.1	82%	0.824	88%	0.876	S	S	*	*	P	Polyproline II helix	trans	-73.9	131.3	-174.2	-173.5	0	0	0	0	110.9	G9	V7-G9 PolarHBondContact O-N 3.39Å
8	K	46.2	Very low	51	Low	195 Å²	195	152.9 Å²	152.9	85%	0.848	88%	0.875	S	S	*	*	P	Polyproline II helix	trans	-65.7	117.1	179.4	-139.1	172.3	-174.3	173.3	0	110.4	V10	K8-V10 PolarHBondContact O-N 3.34Å
9	G	46	Very low	51.3	Low	79 Å²	79	152.1 Å²	152.1	81%	0.814	87%	0.873	S	S	*	*			trans	-71.2	113.6	173.4	0	0	0	0	0	111.9	V7 K11	V7-G9 PolarHBondContact O-N 3.39Å; G9-K11 PolarHBondContact O-N 3.47Å
10	V	55.5	Low	51.5	Low	140 Å²	140	150.7 Å²	150.7	85%	0.848	87%	0.868	S	S	*	*			trans	-82.1	108.8	172.3	178.3	0	0	0	0	108.6	K8 K12	K8-V10 PolarHBondContact O-N 3.34Å; V10-K12 PolarHBondContact O-N 3.34Å
11	K	52.7	Low	51.3	Low	205 Å²	205	153.5 Å²	153.5	89%	0.891	87%	0.87	S	S	*	*	P	Polyproline II helix	trans	-69.9	117.7	171.9	-91.6	-179.7	174.8	175.5	0	109.7	G9	G9-K11 PolarHBondContact O-N 3.47Å
12	K	48.5	Very low	51.6	Low	203 Å²	203	145.2 Å²	145.2	88%	0.883	85%	0.847	S	S	*	*	P	Polyproline II helix	trans	-50.9	136	170.7	-90.8	176.2	171.7	173.6	0	111.6	V10 G14	V10-K12 PolarHBondContact O-N 3.34Å; K12-G14 PolarHBondContact O-N 3.43Å
13	A	49.4	Very low	51.4	Low	104 Å²	104	142.5 Å²	142.5	86%	0.86	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-50.4	125.9	173.4	0	0	0	0	0	111.9
14	G	48.4	Very low	51.5	Low	74 Å²	74	146.7 Å²	146.7	76%	0.763	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-71	138.7	176.9	0	0	0	0	0	111.8	K12	K12-G14 PolarHBondContact O-N 3.43Å
15	K	50.8	Low	51.7	Low	197 Å²	197	144.9 Å²	144.9	86%	0.857	83%	0.825	S	S	*	*			trans	-41.6	133	178.5	-75.5	167.4	170.4	176.2	0	113.6	Q17	K15-Q17 PolarHBondContact O-N 3.17Å
16	T	49.9	Very low	51.9	Low	144 Å²	144	149.9 Å²	149.9	88%	0.883	83%	0.829	S	S	*	*			trans	-47.6	113.5	163.5	20.4	0	0	0	0	111.1	K18	T16-K18 PolarHBondContact O-N 2.99Å
17	Q	57.2	Low	51.8	Low	186 Å²	186	154.6 Å²	154.6	87%	0.869	83%	0.831	S	S	*	*			trans	-71.4	111.1	169.5	-75.7	-180	-21.6	0	0	108.8	K15 V19	K15-Q17 PolarHBondContact O-N 3.17Å; Q17-V19 PolarHBondContact O-N 3.07Å; Q17-V19 VanDerWaalsContact O-N 3.07Å
18	K	50.5	Low	51.8	Low	201 Å²	201	158.4 Å²	158.4	87%	0.874	83%	0.831	S	S	*	*			trans	-58	108.9	164.5	-113.9	179.1	177.1	178.9	0	107.6	T16 T20	T16-K18 PolarHBondContact O-N 2.99Å; K18-T20 PolarHBondContact O-N 3.25Å
19	V	56.3	Low	52.4	Low	137 Å²	137	157.9 Å²	157.9	83%	0.83	83%	0.829	S	S	*	*			trans	-66.9	100.9	169.5	-176.7	0	0	0	0	107	Q17 K21	Q17-V19 PolarHBondContact O-N 3.07Å; Q17-V19 VanDerWaalsContact O-N 3.07Å; V19-K21 PolarHBondContact O-N 3.19Å; V19-K21 VanDerWaalsContact O-N 3.17Å
20	T	54.5	Low	53.1	Low	125 Å²	125	159.1 Å²	159.1	77%	0.767	83%	0.825	S	S	*	*			trans	-60.9	115.2	169	45.6	0	0	0	0	108.1	K18 G22	K18-T20 PolarHBondContact O-N 3.25Å; T20-G22 PolarHBondContact O-N 3.15Å
21	K	48.7	Very low	53.6	Low	210 Å²	210	162.5 Å²	162.5	91%	0.913	82%	0.823	S	S	*	*			trans	-60.9	88.5	162.5	-90	-179.5	172.6	174.7	0	107.4	V19 G23	V19-K21 PolarHBondContact O-N 3.19Å; V19-K21 VanDerWaalsContact O-N 3.17Å; K21-G23 PolarHBondContact O-N 2.81Å; K21-G23 VanDerWaalsContact O-N 3.15Å
22	G	49.6	Very low	54.5	Low	72 Å²	72	161 Å²	161	74%	0.742	82%	0.816	S	S	*	*			trans	-63.8	111	172.6	0	0	0	0	0	108.9	T20	T20-G22 PolarHBondContact O-N 3.15Å
23	G	44.5	Very low	56.1	Low	53 Å²	53	160.7 Å²	160.7	55%	0.546	82%	0.818	S	S	.	*			trans	-58.9	154.4	179.6	0	0	0	0	0	114	K21 K25	K21-G23 PolarHBondContact O-N 2.81Å; K21-G23 VanDerWaalsContact O-N 3.15Å; G23-K25 VanDerWaalsContact C-N 3.29Å; G23-K25 PolarHBondContact O-N 3.02Å
24	D	48.5	Very low	58.2	Low	170 Å²	170	158.1 Å²	158.1	91%	0.909	79%	0.794	S	S	*	*			trans	44.6	37.6	144.4	-59.2	-58.2	0	0	0	118.8	K26	D24-K26 VanDerWaalsContact C-N 3.26Å; D24-K26 PolarHBondContact O-N 2.89Å
25	K	56.8	Low	60.4	Low	170 Å²	170	157.7 Å²	157.7	74%	0.739	77%	0.771	S	S	*	*			trans	-77.4	86.1	155.5	-77.6	-178.7	-178.1	169.4	0	108.4	G23 R27	G23-K25 VanDerWaalsContact C-N 3.29Å; G23-K25 PolarHBondContact O-N 3.02Å; K25-R27 PolarHBondContact O-N 3.03Å
26	K	56.9	Low	62.5	Low	202 Å²	202	149.7 Å²	149.7	88%	0.878	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-2	98.7	159.6	-92.8	178.8	172.5	173	0	110.9	D24 R28	D24-K26 VanDerWaalsContact C-N 3.26Å; D24-K26 PolarHBondContact O-N 2.89Å; K26-R28 PolarHBondContact O-N 2.77Å
27	R	56.6	Low	64.6	Low	243 Å²	243	146.2 Å²	146.2	92%	0.917	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-1.9	88.3	175.9	-73.4	177.3	175	170.2	-2.3	111.4	K25 K29	K25-R27 PolarHBondContact O-N 3.03Å; R27-K29 VanDerWaalsContact C-N 3.28Å; R27-K29 PolarHBondContact O-N 2.9Å
28	R	60.1	Low	66.4	Low	217 Å²	217	144.3 Å²	144.3	82%	0.819	71%	0.706	S	S	*	*			trans	-55	104.5	168	-88.2	-174.9	167.1	-178.9	-4.5	105.2	K26 S30	K26-R28 PolarHBondContact O-N 2.77Å; R28-S30 PolarHBondContact O-N 3.01Å
29	K	59.6	Low	68.6	Low	183 Å²	183	135.7 Å²	135.7	80%	0.796	67%	0.669	S	S	*	*			trans	-46.4	120.2	178.2	-170.6	171	-175.2	173	0	105.8	R27 R31	R27-K29 VanDerWaalsContact C-N 3.28Å; R27-K29 PolarHBondContact O-N 2.9Å; K29-R31 PolarHBondContact O-N 3.05Å
30	S	59.9	Low	70.6	Confident	106 Å²	106	134.8 Å²	134.8	74%	0.741	65%	0.652	S	S	*	*			trans	-43.3	123.1	-179.6	-179.2	0	0	0	0	107.7	R28 K32	R28-S30 PolarHBondContact O-N 3.01Å; S30-K32 PolarHBondContact O-N 2.93Å
31	R	66.7	Low	72.6	Confident	211 Å²	211	135 Å²	135	80%	0.796	64%	0.642	S	S	*	*			trans	-60	110.1	-175.6	-176.6	179.2	-173.7	169.9	1.6	105.9	K29 E33	K29-R31 PolarHBondContact O-N 3.05Å; R31-E33 PolarHBondContact O-N 3.25Å; R31-E33 VanDerWaalsContact O-N 3.1Å
32	K	71.7	Confident	74.8	Confident	174 Å²	174	129.2 Å²	129.2	76%	0.757	62%	0.624	S	S	*	*			trans	-60.3	118.4	173	-75.2	-171.5	172.3	-167.6	0	107	S30 S34	S30-K32 PolarHBondContact O-N 2.93Å; K32-S34 PolarHBondContact O-N 3.33Å
33	E	81.4	Confident	77.1	Confident	195 Å²	195	127.3 Å²	127.3	91%	0.911	60%	0.597	S	S	*	*			trans	-59.4	124.8	169.9	-66.3	-177.1	160.5	0	0	107.6	R31	R31-E33 PolarHBondContact O-N 3.25Å; R31-E33 VanDerWaalsContact O-N 3.1Å
34	S	93.1	Very high	79.7	Confident	51 Å²	51	128 Å²	128	36%	0.357	58%	0.584	S	S	.	*			trans	-155.9	144.1	-174	171.7	0	0	0	0	109.7	K32 A36 N61	K32-S34 PolarHBondContact O-N 3.33Å; S34-A36 PolarHBondContact O-N 3.21Å; S34-A36 WeakPolarHBondContact OG-CB 3.34Å; S34-A36 PolarHBondContact OG-N 3.28Å; S34-A36 VanDerWaalsContact OG-N 3.1Å; S34-N61 WeakPolarHBondContact CA-OD1 3.49Å; S34-N61 WeakPolarHBondContact CB-OD1 3.38Å; S34-N61 PolarHBondContact OG-OD1 3.2Å
35	F	95.1	Very high	82	Confident	64 Å²	64	127.7 Å²	127.7	28%	0.281	58%	0.578	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.2	-0.2	174.8	-66.3	-79.9	0	0	0	113.3	T37 Y38 I39 N61 V64 N65	F35-T37 PolarHBondContact O-N 3.22Å; F35-T37 VanDerWaalsContact O-N 3.1Å; F35-Y38 HydrophobicContact CD1-CD2 4.14Å; F35-Y38 PolarHBondContact O-N 3.47Å; F35-I39 HydrophobicContact CB-CD1 3.99Å; F35-I39 HydrophobicContact CB-CG1 4.33Å; F35-I39 WeakPolarHBondContact O-CG1 3.26Å; F35-I39 PolarHBondContact O-N 3.35Å; F35-N61 PolarHBondContact N-OD1 3.15Å; F35-V64 HydrophobicContact CB-CB 4.43Å; F35-V64 HydrophobicContact CB-CG1 4.18Å; F35-V64 HydrophobicContact CD1-CG1 3.82Å; F35-V64 HydrophobicContact CD2-CB 4.04Å; F35-V64 HydrophobicContact CD2-CG1 3.49Å; F35-V64 VanDerWaalsContact CD2-CG1 3.49Å; F35-V64 HydrophobicContact CE1-CG1 4.03Å; F35-V64 HydrophobicContact CE2-CG1 3.72Å; F35-V64 HydrophobicContact CG-CB 4.22Å; F35-V64 HydrophobicContact CG-CG1 3.54Å; F35-V64 HydrophobicContact CZ-CG1 3.98Å; F35-N65 WeakPolarHBondContact CE2-OD1 3.21Å
36	A	94.8	Very high	83.9	Confident	29 Å²	29	124 Å²	124	24%	0.24	57%	0.569	C	S	.	*	H	α-helix	trans	-53.5	-37.5	-173.6	0	0	0	0	0	114	S34 Y38 Y40 M57	S34-A36 PolarHBondContact O-N 3.21Å; S34-A36 WeakPolarHBondContact OG-CB 3.34Å; S34-A36 PolarHBondContact OG-N 3.28Å; S34-A36 VanDerWaalsContact OG-N 3.1Å; A36-Y38 VanDerWaalsContact C-N 3.35Å; A36-Y38 PolarHBondContact O-N 2.93Å; A36-Y40 WeakPolarHBondContact O-CB 3.44Å; A36-Y40 PolarHBondContact O-N 2.98Å; A36-M57 HydrophobicContact CB-CG 4Å; A36-M57 HydrophobicContact CB-SD 3.72Å
37	T	94.8	Very high	85.8	Confident	71 Å²	71	119.2 Å²	119.2	44%	0.436	55%	0.55	S	S	.	.	H	α-helix	trans	-64.4	-40.6	177.3	-57.5	0	0	0	0	111.5	F35 K41	F35-T37 PolarHBondContact O-N 3.22Å; F35-T37 VanDerWaalsContact O-N 3.1Å; T37-K41 WeakPolarHBondContact O-CG 3.48Å; T37-K41 PolarHBondContact O-N 3.17Å; T37-K41 VanDerWaalsContact O-N 3.07Å
38	Y	95.2	Very high	87.8	Confident	146 Å²	146	111.4 Å²	111.4	57%	0.573	53%	0.531	S	S	*	.	H	α-helix	trans	-76	-40.1	-178.9	-53.9	-73	0	0	0	111.5	F35 A36 Y40 K41 V42	F35-Y38 HydrophobicContact CD1-CD2 4.14Å; F35-Y38 PolarHBondContact O-N 3.47Å; A36-Y38 VanDerWaalsContact C-N 3.35Å; A36-Y38 PolarHBondContact O-N 2.93Å; Y38-Y40 VanDerWaalsContact C-N 3.27Å; Y38-Y40 PolarHBondContact O-N 2.78Å; Y38-K41 PolarHBondContact O-N 3.37Å; Y38-V42 WeakPolarHBondContact O-CG2 3.34Å; Y38-V42 PolarHBondContact O-N 3.06Å
39	I	96.9	Very high	89.6	Confident	21 Å²	21	108.8 Å²	108.8	11%	0.108	53%	0.533	C	S	.	.	H	α-helix	trans	-56	-46.2	173.4	-65.5	162.3	0	0	0	109.8	F35 V42 L43 I52 M57 M60 N61	F35-I39 HydrophobicContact CB-CD1 3.99Å; F35-I39 HydrophobicContact CB-CG1 4.33Å; F35-I39 WeakPolarHBondContact O-CG1 3.26Å; F35-I39 PolarHBondContact O-N 3.35Å; I39-V42 PolarHBondContact O-N 2.91Å; I39-L43 WeakPolarHBondContact O-CB 3.34Å; I39-L43 PolarHBondContact O-N 3.1Å; I39-I52 HydrophobicContact CG2-CD1 4.32Å; I39-M57 HydrophobicContact CB-CE 4.5Å; I39-M57 HydrophobicContact CB-SD 3.89Å; I39-M57 HydrophobicContact CD1-SD 4.08Å; I39-M57 HydrophobicContact CG2-CE 4.17Å; I39-M57 HydrophobicContact CG2-SD 3.73Å; I39-M60 HydrophobicContact CD1-CB 3.82Å; I39-M60 HydrophobicContact CG1-CB 4.47Å; I39-M60 HydrophobicContact CG2-CB 4.13Å; I39-N61 HydrophobicContact CD1-CB 4.24Å
40	Y	96.8	Very high	91.4	Very high	118 Å²	118	103.4 Å²	103.4	46%	0.463	52%	0.515	S	S	.	.	H	α-helix	trans	-65.4	-41.7	177.3	-171.5	-99.6	0	0	0	113.1	A36 Y38 L43 K44 I52	A36-Y40 WeakPolarHBondContact O-CB 3.44Å; A36-Y40 PolarHBondContact O-N 2.98Å; Y38-Y40 VanDerWaalsContact C-N 3.27Å; Y38-Y40 PolarHBondContact O-N 2.78Å; Y40-L43 PolarHBondContact O-N 3.24Å; Y40-K44 HydrophobicContact CD1-CG 4.25Å; Y40-K44 HydrophobicContact CE1-CG 3.78Å; Y40-K44 HydrophobicContact CE2-CG 4.28Å; Y40-K44 PolarHBondContact O-N 2.99Å; Y40-K44 WeakPolarHBondContact OH-CE 3.49Å; Y40-I52 HydrophobicContact CD2-CG2 4.49Å
41	K	96.3	Very high	93.1	Very high	130 Å²	130	101.1 Å²	101.1	57%	0.565	51%	0.509	S	S	*	.	H	α-helix	trans	-60.4	-45.6	176.5	-78.2	177.9	177.9	-174.2	0	112	T37 Y38 K44 Q45	T37-K41 WeakPolarHBondContact O-CG 3.48Å; T37-K41 PolarHBondContact O-N 3.17Å; T37-K41 VanDerWaalsContact O-N 3.07Å; Y38-K41 PolarHBondContact O-N 3.37Å; K41-K44 PolarHBondContact O-N 2.89Å; K41-Q45 WeakPolarHBondContact O-CB 3.42Å; K41-Q45 PolarHBondContact O-N 3.45Å; K41-Q45 VanDerWaalsContact O-N 3.1Å
42	V	96.2	Very high	94.6	Very high	88 Å²	88	93.7 Å²	93.7	53%	0.533	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-43.2	177.9	175.2	0	0	0	0	110.4	Y38 I39 K44 Q45 V46	Y38-V42 WeakPolarHBondContact O-CG2 3.34Å; Y38-V42 PolarHBondContact O-N 3.06Å; I39-V42 PolarHBondContact O-N 2.91Å; V42-K44 PolarHBondContact O-N 3.39Å; V42-Q45 WeakPolarHBondContact O-CB 3.26Å; V42-Q45 PolarHBondContact O-N 2.92Å; V42-Q45 VanDerWaalsContact O-N 3.15Å; V42-V46 PolarHBondContact O-N 3.36Å; V42-V46 VanDerWaalsContact O-N 3.13Å
43	L	97.6	Very high	95.8	Very high	32 Å²	32	88.8 Å²	88.8	17%	0.168	47%	0.472	C	S	.	.	H	α-helix	trans	-56	-48.8	176.1	176.3	64.5	0	0	0	111.6	I39 Y40 Q45 V46 H47 T50 I52	I39-L43 WeakPolarHBondContact O-CB 3.34Å; I39-L43 PolarHBondContact O-N 3.1Å; Y40-L43 PolarHBondContact O-N 3.24Å; L43-Q45 VanDerWaalsContact C-N 3.26Å; L43-Q45 PolarHBondContact O-N 3.41Å; L43-V46 PolarHBondContact O-N 2.89Å; L43-H47 HydrophobicContact CD1-CB 4.31Å; L43-H47 CarbonylContact O-C 3.46Å; L43-H47 WeakPolarHBondContact O-CA 3.19Å; L43-H47 PolarHBondContact O-N 3.16Å; L43-T50 HydrophobicContact CD1-CG2 4.46Å; L43-I52 HydrophobicContact CD2-CB 3.71Å; L43-I52 HydrophobicContact CD2-CG2 3.67Å
44	K	97.9	Very high	96.6	Very high	66 Å²	66	84.8 Å²	84.8	29%	0.287	47%	0.465	S	S	.	.	H	α-helix	trans	-70.5	-21.6	-179.7	-69.5	-53.8	-168	-175.7	0	114	Y40 K41 V42 P48 T50	Y40-K44 HydrophobicContact CD1-CG 4.25Å; Y40-K44 HydrophobicContact CE1-CG 3.78Å; Y40-K44 HydrophobicContact CE2-CG 4.28Å; Y40-K44 PolarHBondContact O-N 2.99Å; Y40-K44 WeakPolarHBondContact OH-CE 3.49Å; K41-K44 PolarHBondContact O-N 2.89Å; V42-K44 PolarHBondContact O-N 3.39Å; K44-P48 WeakPolarHBondContact CD-O 3.29Å; K44-P48 PolarHBondContact NZ-O 2.92Å; K44-T50 PolarHBondContact NZ-O 2.91Å
45	Q	97	Very high	96.8	Very high	165 Å²	165	89.9 Å²	89.9	77%	0.771	48%	0.481	S	S	*	.	H	α-helix	trans	-74.4	-33.3	172.8	-174.1	178.6	-28.5	0	0	112.2	K41 V42 L43	K41-Q45 WeakPolarHBondContact O-CB 3.42Å; K41-Q45 PolarHBondContact O-N 3.45Å; K41-Q45 VanDerWaalsContact O-N 3.1Å; V42-Q45 WeakPolarHBondContact O-CB 3.26Å; V42-Q45 PolarHBondContact O-N 2.92Å; V42-Q45 VanDerWaalsContact O-N 3.15Å; L43-Q45 VanDerWaalsContact C-N 3.26Å; L43-Q45 PolarHBondContact O-N 3.41Å
46	V	97.8	Very high	96.9	Very high	91 Å²	91	88.3 Å²	88.3	55%	0.552	48%	0.48	S	S	*	.	H	α-helix	trans	-96.6	-37.5	-177.1	-176.1	0	0	0	0	112.4	V42 L43	V42-V46 PolarHBondContact O-N 3.36Å; V42-V46 VanDerWaalsContact O-N 3.13Å; L43-V46 PolarHBondContact O-N 2.89Å
47	H	97.6	Very high	97	Very high	103 Å²	103	88.5 Å²	88.5	48%	0.477	48%	0.476	S	S	.	.			trans	-135.8	83.1	-179	-60.8	-62.5	0	0	0	111.1	L43 D49 T50	L43-H47 HydrophobicContact CD1-CB 4.31Å; L43-H47 CarbonylContact O-C 3.46Å; L43-H47 WeakPolarHBondContact O-CA 3.19Å; L43-H47 PolarHBondContact O-N 3.16Å; H47-D49 VanDerWaalsContact C-N 3.27Å; H47-D49 PolarHBondContact O-N 3.44Å; H47-T50 PolarHBondContact O-N 2.87Å
48	P	97.6	Very high	97.1	Very high	79 Å²	79	88.7 Å²	88.7	51%	0.513	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-37.4	-176.9	-26.5	35.4	0	0	0	113.9	K44	K44-P48 WeakPolarHBondContact CD-O 3.29Å; K44-P48 PolarHBondContact NZ-O 2.92Å
49	D	97.6	Very high	97.2	Very high	162 Å²	162	86.7 Å²	86.7	87%	0.866	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-3.6	-174.1	-53	-45.3	0	0	0	113.7	H47	H47-D49 VanDerWaalsContact C-N 3.27Å; H47-D49 PolarHBondContact O-N 3.44Å
50	T	97.2	Very high	97.3	Very high	69 Å²	69	89.4 Å²	89.4	42%	0.423	49%	0.492	S	S	.	.			trans	-96.4	138.6	-178.4	-60.6	0	0	0	0	111.6	L43 K44 H47	L43-T50 HydrophobicContact CD1-CG2 4.46Å; K44-T50 PolarHBondContact NZ-O 2.91Å; H47-T50 PolarHBondContact O-N 2.87Å
51	G	96.7	Very high	97.3	Very high	59 Å²	59	85 Å²	85	61%	0.608	48%	0.476	S	S	*	.			trans	-100.6	170	170.6	0	0	0	0	0	112.2
52	I	97.7	Very high	97.3	Very high	54 Å²	54	81.9 Å²	81.9	28%	0.277	47%	0.471	S	S	.	.			trans	-131.2	133.6	175.2	-174.9	170.7	0	0	0	109.5	I39 Y40 L43 A56 M57 M60	I39-I52 HydrophobicContact CG2-CD1 4.32Å; Y40-I52 HydrophobicContact CD2-CG2 4.49Å; L43-I52 HydrophobicContact CD2-CB 3.71Å; L43-I52 HydrophobicContact CD2-CG2 3.67Å; I52-A56 HydrophobicContact CD1-CB 4.07Å; I52-A56 HydrophobicContact CG1-CB 3.6Å; I52-M57 HydrophobicContact CD1-CE 4.43Å; I52-M57 HydrophobicContact CG2-CE 3.56Å; I52-M60 HydrophobicContact CD1-CG 4.26Å
53	S	97.7	Very high	97.3	Very high	72 Å²	72	83.4 Å²	83.4	50%	0.503	47%	0.471	S	S	.	.			trans	-71	159	178.1	72.4	0	0	0	0	111.6	K55 A56 M57	S53-K55 VanDerWaalsContact C-N 3.28Å; S53-K55 PolarHBondContact O-N 2.97Å; S53-A56 PolarHBondContact O-N 2.78Å; S53-A56 WeakPolarHBondContact OG-CB 3.45Å; S53-A56 PolarHBondContact OG-N 3.4Å; S53-A56 VanDerWaalsContact OG-N 3.14Å; S53-M57 WeakPolarHBondContact O-CB 3.44Å; S53-M57 PolarHBondContact O-N 3.28Å
54	S	96.4	Very high	97.3	Very high	110 Å²	110	83.9 Å²	83.9	77%	0.769	48%	0.475	S	S	*	.	H	α-helix	trans	-60.3	-37.9	176.1	56.5	0	0	0	0	112.5	M57 S58	S54-M57 PolarHBondContact O-N 3.35Å; S54-S58 PolarHBondContact O-N 3.48Å
55	K	97.6	Very high	97.3	Very high	158 Å²	158	83.7 Å²	83.7	69%	0.687	48%	0.477	S	S	*	.	H	α-helix	trans	-63.7	-47.8	175.2	-172.3	175.7	-178.7	179.6	0	111.2	S53 M57 S58 I59	S53-K55 VanDerWaalsContact C-N 3.28Å; S53-K55 PolarHBondContact O-N 2.97Å; K55-M57 VanDerWaalsContact C-N 3.34Å; K55-M57 PolarHBondContact O-N 3.31Å; K55-S58 WeakPolarHBondContact O-CB 3.5Å; K55-S58 PolarHBondContact O-N 2.52Å; K55-I59 HydrophobicContact CG-CD1 4.31Å; K55-I59 WeakPolarHBondContact O-CG1 3.44Å; K55-I59 PolarHBondContact O-N 3.49Å
56	A	98	Very high	97.3	Very high	31 Å²	31	79 Å²	79	26%	0.256	46%	0.457	S	S	.	.	H	α-helix	trans	-63.2	-40.3	176.9	0	0	0	0	0	111.8	I52 S53 S58 I59 M60	I52-A56 HydrophobicContact CD1-CB 4.07Å; I52-A56 HydrophobicContact CG1-CB 3.6Å; S53-A56 PolarHBondContact O-N 2.78Å; S53-A56 WeakPolarHBondContact OG-CB 3.45Å; S53-A56 PolarHBondContact OG-N 3.4Å; S53-A56 VanDerWaalsContact OG-N 3.14Å; A56-S58 VanDerWaalsContact C-N 3.32Å; A56-S58 PolarHBondContact O-N 3.21Å; A56-I59 PolarHBondContact O-N 3.14Å; A56-M60 WeakPolarHBondContact O-CG 3.34Å; A56-M60 PolarHBondContact O-N 3.49Å
57	M	97	Very high	97.2	Very high	34 Å²	34	76.7 Å²	76.7	17%	0.167	44%	0.443	C	S	.	.	H	α-helix	trans	-59.2	-42	174.2	-175.4	62.8	75.9	0	0	112	A36 I39 I52 S53 S54 K55 M60 N61	A36-M57 HydrophobicContact CB-CG 4Å; A36-M57 HydrophobicContact CB-SD 3.72Å; I39-M57 HydrophobicContact CB-CE 4.5Å; I39-M57 HydrophobicContact CB-SD 3.89Å; I39-M57 HydrophobicContact CD1-SD 4.08Å; I39-M57 HydrophobicContact CG2-CE 4.17Å; I39-M57 HydrophobicContact CG2-SD 3.73Å; I52-M57 HydrophobicContact CD1-CE 4.43Å; I52-M57 HydrophobicContact CG2-CE 3.56Å; S53-M57 WeakPolarHBondContact O-CB 3.44Å; S53-M57 PolarHBondContact O-N 3.28Å; S54-M57 PolarHBondContact O-N 3.35Å; K55-M57 VanDerWaalsContact C-N 3.34Å; K55-M57 PolarHBondContact O-N 3.31Å; M57-M60 PolarHBondContact O-N 3.2Å; M57-N61 WeakPolarHBondContact O-CB 3.24Å; M57-N61 PolarHBondContact O-N 2.74Å
58	S	96.4	Very high	97.2	Very high	75 Å²	75	77.9 Å²	77.9	52%	0.524	45%	0.447	S	S	.	.	H	α-helix	trans	-64.9	-40.1	176.7	-168.6	0	0	0	0	112.4	S54 K55 A56 S62	S54-S58 PolarHBondContact O-N 3.48Å; K55-S58 WeakPolarHBondContact O-CB 3.5Å; K55-S58 PolarHBondContact O-N 2.52Å; A56-S58 VanDerWaalsContact C-N 3.32Å; A56-S58 PolarHBondContact O-N 3.21Å; S58-S62 PolarHBondContact O-N 3.05Å; S58-S62 PolarHBondContact O-OG 2.77Å
59	I	97.7	Very high	97.1	Very high	103 Å²	103	79.1 Å²	79.1	53%	0.528	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-49.4	176.1	-66.9	166	0	0	0	109.7	K55 A56 N61 S62 F63	K55-I59 HydrophobicContact CG-CD1 4.31Å; K55-I59 WeakPolarHBondContact O-CG1 3.44Å; K55-I59 PolarHBondContact O-N 3.49Å; A56-I59 PolarHBondContact O-N 3.14Å; I59-N61 VanDerWaalsContact C-N 3.34Å; I59-N61 PolarHBondContact O-N 2.97Å; I59-S62 PolarHBondContact O-N 3.39Å; I59-S62 VanDerWaalsContact O-N 3.14Å; I59-F63 PolarHBondContact O-N 3.22Å
60	M	97.8	Very high	97.2	Very high	78 Å²	78	78 Å²	78	38%	0.384	43%	0.433	S	S	.	.	H	α-helix	trans	-61.7	-40.7	179	-70.1	-57.9	-63.7	0	0	112.4	I39 I52 A56 M57 S62 F63 V64	I39-M60 HydrophobicContact CD1-CB 3.82Å; I39-M60 HydrophobicContact CG1-CB 4.47Å; I39-M60 HydrophobicContact CG2-CB 4.13Å; I52-M60 HydrophobicContact CD1-CG 4.26Å; A56-M60 WeakPolarHBondContact O-CG 3.34Å; A56-M60 PolarHBondContact O-N 3.49Å; M57-M60 PolarHBondContact O-N 3.2Å; M60-S62 VanDerWaalsContact C-N 3.32Å; M60-S62 PolarHBondContact O-N 2.79Å; M60-F63 PolarHBondContact O-N 3.49Å; M60-V64 WeakPolarHBondContact O-CG2 3.37Å; M60-V64 PolarHBondContact O-N 3.48Å
61	N	96.5	Very high	97.2	Very high	25 Å²	25	76.2 Å²	76.2	13%	0.134	42%	0.421	C	S	.	.	H	α-helix	trans	-62.2	-41.2	175.3	-175.7	90.7	0	0	0	111.8	S34 F35 I39 M57 I59 V64 N65	S34-N61 WeakPolarHBondContact CA-OD1 3.49Å; S34-N61 WeakPolarHBondContact CB-OD1 3.38Å; S34-N61 PolarHBondContact OG-OD1 3.2Å; F35-N61 PolarHBondContact N-OD1 3.15Å; I39-N61 HydrophobicContact CD1-CB 4.24Å; M57-N61 WeakPolarHBondContact O-CB 3.24Å; M57-N61 PolarHBondContact O-N 2.74Å; I59-N61 VanDerWaalsContact C-N 3.34Å; I59-N61 PolarHBondContact O-N 2.97Å; N61-V64 PolarHBondContact O-N 3.22Å; N61-N65 PolarHBondContact ND2-ND2 3.44Å; N61-N65 PolarHBondContact O-N 3.07Å; N61-N65 VanDerWaalsContact O-N 3.08Å; N61-N65 PolarHBondContact O-ND2 3.06Å
62	S	97	Very high	97.2	Very high	65 Å²	65	74.9 Å²	74.9	46%	0.455	41%	0.407	S	S	.	.	H	α-helix	trans	-68.3	-38.2	178	-51.9	0	0	0	0	111.6	S58 I59 M60 N65 D66	S58-S62 PolarHBondContact O-N 3.05Å; S58-S62 PolarHBondContact O-OG 2.77Å; I59-S62 PolarHBondContact O-N 3.39Å; I59-S62 VanDerWaalsContact O-N 3.14Å; M60-S62 VanDerWaalsContact C-N 3.32Å; M60-S62 PolarHBondContact O-N 2.79Å; S62-N65 PolarHBondContact O-N 2.57Å; S62-D66 PolarHBondContact O-N 3.13Å
63	F	97.5	Very high	97.3	Very high	121 Å²	121	74.9 Å²	74.9	53%	0.531	42%	0.415	S	S	.	.	H	α-helix	trans	-60.5	-46	173.6	172.7	-109.4	0	0	0	112	I59 M60 N65 D66 V67	I59-F63 PolarHBondContact O-N 3.22Å; M60-F63 PolarHBondContact O-N 3.49Å; F63-N65 VanDerWaalsContact C-N 3.31Å; F63-N65 PolarHBondContact O-N 3.14Å; F63-D66 PolarHBondContact O-N 3.46Å; F63-V67 HydrophobicContact CD2-CG2 4.29Å; F63-V67 HydrophobicContact CE1-CG2 4.43Å; F63-V67 HydrophobicContact CE2-CG2 3.81Å; F63-V67 HydrophobicContact CZ-CG2 3.89Å; F63-V67 WeakPolarHBondContact O-CG2 3.37Å; F63-V67 PolarHBondContact O-N 2.94Å; F63-V67 VanDerWaalsContact O-N 3.07Å
64	V	97	Very high	97.3	Very high	42 Å²	42	72.6 Å²	72.6	26%	0.255	40%	0.396	S	S	.	.	H	α-helix	trans	-61.9	-41.1	176.6	175.9	0	0	0	0	111.1	F35 M60 N61 V67 F68	F35-V64 HydrophobicContact CB-CB 4.43Å; F35-V64 HydrophobicContact CB-CG1 4.18Å; F35-V64 HydrophobicContact CD1-CG1 3.82Å; F35-V64 HydrophobicContact CD2-CB 4.04Å; F35-V64 HydrophobicContact CD2-CG1 3.49Å; F35-V64 VanDerWaalsContact CD2-CG1 3.49Å; F35-V64 HydrophobicContact CE1-CG1 4.03Å; F35-V64 HydrophobicContact CE2-CG1 3.72Å; F35-V64 HydrophobicContact CG-CB 4.22Å; F35-V64 HydrophobicContact CG-CG1 3.54Å; F35-V64 HydrophobicContact CZ-CG1 3.98Å; M60-V64 WeakPolarHBondContact O-CG2 3.37Å; M60-V64 PolarHBondContact O-N 3.48Å; N61-V64 PolarHBondContact O-N 3.22Å; V64-V67 PolarHBondContact O-N 3.45Å; V64-F68 VanDerWaalsContact O-CB 3.22Å; V64-F68 WeakPolarHBondContact O-CB 3.22Å; V64-F68 PolarHBondContact O-N 3.18Å
65	N	96.6	Very high	97.4	Very high	61 Å²	61	67.3 Å²	67.3	33%	0.326	36%	0.359	S	S	.	.	H	α-helix	trans	-62.2	-46.4	176	-72.6	-21	0	0	0	112.3	F35 N61 S62 F63 V67 F68 D69	F35-N65 WeakPolarHBondContact CE2-OD1 3.21Å; N61-N65 PolarHBondContact ND2-ND2 3.44Å; N61-N65 PolarHBondContact O-N 3.07Å; N61-N65 VanDerWaalsContact O-N 3.08Å; N61-N65 PolarHBondContact O-ND2 3.06Å; S62-N65 PolarHBondContact O-N 2.57Å; F63-N65 VanDerWaalsContact C-N 3.31Å; F63-N65 PolarHBondContact O-N 3.14Å; N65-V67 PolarHBondContact O-N 2.87Å; N65-F68 WeakPolarHBondContact O-CB 3.29Å; N65-F68 PolarHBondContact O-N 2.89Å; N65-D69 PolarHBondContact O-N 3.43Å
66	D	97.2	Very high	97.4	Very high	67 Å²	67	62.9 Å²	62.9	36%	0.358	35%	0.348	S	S	.	.	H	α-helix	trans	-59.1	-46.2	178.5	-179.6	23.1	0	0	0	111.5	S62 F63 F68 D69 R70	S62-D66 PolarHBondContact O-N 3.13Å; F63-D66 PolarHBondContact O-N 3.46Å; D66-F68 PolarHBondContact O-N 3.39Å; D66-D69 PolarHBondContact O-N 3.46Å; D66-R70 VanDerWaalsContact CG-NH2 3.34Å; D66-R70 VanDerWaalsContact O-CG 3.24Å; D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.29Å; D66-R70 IonicContact OD1-CZ 2.57Å; D66-R70 IonicContact OD1-NE 2.75Å; D66-R70 PolarHBondContact OD1-NE 3.08Å; D66-R70 IonicContact OD1-NH2 3.1Å; D66-R70 PolarHBondContact OD1-NH2 3.43Å; D66-R70 VanDerWaalsContact OD1-NH2 3.13Å; D66-R70 IonicContact OD2-CZ 3.43Å; D66-R70 IonicContact OD2-NE 3.57Å; D66-R70 IonicContact OD2-NH2 2.77Å; D66-R70 PolarHBondContact OD2-NH2 3.32Å
67	V	96.7	Very high	97.4	Very high	43 Å²	43	67.8 Å²	67.8	26%	0.261	36%	0.36	S	S	.	.	H	α-helix	trans	-65.1	-40.2	176.3	176.3	0	0	0	0	111.6	F63 V64 N65 R70 I71	F63-V67 HydrophobicContact CD2-CG2 4.29Å; F63-V67 HydrophobicContact CE1-CG2 4.43Å; F63-V67 HydrophobicContact CE2-CG2 3.81Å; F63-V67 HydrophobicContact CZ-CG2 3.89Å; F63-V67 WeakPolarHBondContact O-CG2 3.37Å; F63-V67 PolarHBondContact O-N 2.94Å; F63-V67 VanDerWaalsContact O-N 3.07Å; V64-V67 PolarHBondContact O-N 3.45Å; N65-V67 PolarHBondContact O-N 2.87Å; V67-R70 PolarHBondContact O-N 3.5Å; V67-I71 HydrophobicContact CG1-CD1 3.78Å; V67-I71 HydrophobicContact CG1-CG1 4.43Å; V67-I71 VanDerWaalsContact O-CG1 3.29Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.26Å
68	F	96.6	Very high	97.4	Very high	127 Å²	127	67.3 Å²	67.3	56%	0.557	36%	0.358	S	S	*	.	H	α-helix	trans	-61.7	-48	178.1	179.1	-91.2	0	0	0	111.8	V64 N65 D66 R70 I71 G72	V64-F68 VanDerWaalsContact O-CB 3.22Å; V64-F68 WeakPolarHBondContact O-CB 3.22Å; V64-F68 PolarHBondContact O-N 3.18Å; N65-F68 WeakPolarHBondContact O-CB 3.29Å; N65-F68 PolarHBondContact O-N 2.89Å; D66-F68 PolarHBondContact O-N 3.39Å; F68-R70 VanDerWaalsContact C-N 3.34Å; F68-R70 PolarHBondContact O-N 3.07Å; F68-I71 PolarHBondContact O-N 3Å; F68-G72 PolarHBondContact O-N 3.46Å
69	D	97.1	Very high	97.5	Very high	106 Å²	106	64 Å²	64	57%	0.567	34%	0.335	S	S	*	.	H	α-helix	trans	-63.3	-41.1	179.6	-71.6	-18.8	0	0	0	111.1	N65 D66 G72 A73	N65-D69 PolarHBondContact O-N 3.43Å; D66-D69 PolarHBondContact O-N 3.46Å; D69-G72 PolarHBondContact O-N 3.45Å; D69-A73 WeakPolarHBondContact O-CB 3.24Å; D69-A73 PolarHBondContact O-N 2.85Å
70	R	97.9	Very high	97.5	Very high	139 Å²	139	65.7 Å²	65.7	53%	0.525	34%	0.341	S	S	.	.	H	α-helix	trans	-61	-46	174.5	-70.7	175.8	-163.1	-156.4	7.3	112.1	D66 V67 F68 A73 E74 L99	D66-R70 VanDerWaalsContact CG-NH2 3.34Å; D66-R70 VanDerWaalsContact O-CG 3.24Å; D66-R70 WeakPolarHBondContact O-CG 3.48Å; D66-R70 PolarHBondContact O-N 3.29Å; D66-R70 IonicContact OD1-CZ 2.57Å; D66-R70 IonicContact OD1-NE 2.75Å; D66-R70 PolarHBondContact OD1-NE 3.08Å; D66-R70 IonicContact OD1-NH2 3.1Å; D66-R70 PolarHBondContact OD1-NH2 3.43Å; D66-R70 VanDerWaalsContact OD1-NH2 3.13Å; D66-R70 IonicContact OD2-CZ 3.43Å; D66-R70 IonicContact OD2-NE 3.57Å; D66-R70 IonicContact OD2-NH2 2.77Å; D66-R70 PolarHBondContact OD2-NH2 3.32Å; V67-R70 PolarHBondContact O-N 3.5Å; F68-R70 VanDerWaalsContact C-N 3.34Å; F68-R70 PolarHBondContact O-N 3.07Å; R70-A73 PolarHBondContact O-N 2.72Å; R70-E74 WeakPolarHBondContact O-CB 3.43Å; R70-E74 PolarHBondContact O-N 3.01Å; R70-L99 VanDerWaalsContact C-CD1 3.48Å; R70-L99 HydrophobicContact CB-CD1 3.94Å; R70-L99 HydrophobicContact CB-CD2 4.22Å
71	I	97.8	Very high	97.4	Very high	31 Å²	31	69.9 Å²	69.9	16%	0.159	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-44.6	177.6	-68.4	165.3	0	0	0	110.4	V67 F68 E74 A75 I92 A95 V96 L99	V67-I71 HydrophobicContact CG1-CD1 3.78Å; V67-I71 HydrophobicContact CG1-CG1 4.43Å; V67-I71 VanDerWaalsContact O-CG1 3.29Å; V67-I71 WeakPolarHBondContact O-CG1 3.24Å; V67-I71 PolarHBondContact O-N 3.26Å; F68-I71 PolarHBondContact O-N 3Å; I71-E74 PolarHBondContact O-N 3.36Å; I71-A75 VanDerWaalsContact O-CB 3.26Å; I71-A75 WeakPolarHBondContact O-CB 3.48Å; I71-A75 PolarHBondContact O-N 2.84Å; I71-I92 HydrophobicContact CG2-CG2 4.29Å; I71-A95 HydrophobicContact CG2-CB 4.23Å; I71-V96 HydrophobicContact CD1-CG2 3.98Å; I71-V96 HydrophobicContact CG1-CG2 4.28Å; I71-V96 HydrophobicContact CG2-CG2 4.26Å; I71-L99 VanDerWaalsContact CA-CD1 3.48Å; I71-L99 HydrophobicContact CB-CD1 4.15Å; I71-L99 HydrophobicContact CG1-CD1 3.57Å
72	G	97.7	Very high	97.4	Very high	31 Å²	31	72.2 Å²	72.2	32%	0.32	37%	0.366	S	S	.	.	H	α-helix	trans	-60.8	-45.8	178.1	0	0	0	0	0	112.4	F68 D69 A75 S76	F68-G72 PolarHBondContact O-N 3.46Å; D69-G72 PolarHBondContact O-N 3.45Å; G72-A75 PolarHBondContact O-N 3.19Å; G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.45Å
73	A	98.1	Very high	97.4	Very high	54 Å²	54	76 Å²	76	45%	0.446	38%	0.381	S	S	.	.	H	α-helix	trans	-62.5	-45.2	177	0	0	0	0	0	112	D69 R70 S76 R77	D69-A73 WeakPolarHBondContact O-CB 3.24Å; D69-A73 PolarHBondContact O-N 2.85Å; R70-A73 PolarHBondContact O-N 2.72Å; A73-S76 PolarHBondContact O-N 3.1Å; A73-R77 WeakPolarHBondContact O-CG 3.41Å; A73-R77 PolarHBondContact O-N 3.49Å
74	E	98.2	Very high	97.3	Very high	23 Å²	23	76.6 Å²	76.6	11%	0.107	38%	0.38	C	S	.	.	H	α-helix	trans	-64.5	-44.4	177.5	-172.2	60.1	-144.4	0	0	112	R70 I71 S76 R77 L78 A95 L98 L99	R70-E74 WeakPolarHBondContact O-CB 3.43Å; R70-E74 PolarHBondContact O-N 3.01Å; I71-E74 PolarHBondContact O-N 3.36Å; E74-S76 VanDerWaalsContact C-N 3.29Å; E74-S76 PolarHBondContact O-N 3.42Å; E74-R77 WeakPolarHBondContact O-CB 3.42Å; E74-R77 PolarHBondContact O-N 3.05Å; E74-R77 VanDerWaalsContact O-N 3.16Å; E74-R77 IonicContact OE2-CZ 3.13Å; E74-R77 IonicContact OE2-NE 3.24Å; E74-R77 PolarHBondContact OE2-NE 2.94Å; E74-R77 IonicContact OE2-NH2 3.37Å; E74-R77 PolarHBondContact OE2-NH2 3.49Å; E74-L78 HydrophobicContact CG-CD1 4.31Å; E74-L78 WeakPolarHBondContact O-CG 3.35Å; E74-L78 PolarHBondContact O-N 3.33Å; E74-A95 HydrophobicContact CB-CB 3.7Å; E74-A95 HydrophobicContact CG-CB 3.65Å; E74-L98 HydrophobicContact CG-CB 4.38Å; E74-L98 HydrophobicContact CG-CD1 4.01Å; E74-L98 VanDerWaalsContact OE1-CD1 3.24Å; E74-L98 WeakPolarHBondContact OE1-CD1 3.41Å; E74-L99 HydrophobicContact CB-CD1 4.16Å
75	A	98.2	Very high	97.2	Very high	0 Å²	0	84 Å²	84	0%	0	41%	0.411	C	S	.	.	H	α-helix	trans	-63.6	-36.6	177.6	0	0	0	0	0	112	I71 G72 L78 A79 I87 E91 I92 A95	I71-A75 VanDerWaalsContact O-CB 3.26Å; I71-A75 WeakPolarHBondContact O-CB 3.48Å; I71-A75 PolarHBondContact O-N 2.84Å; G72-A75 PolarHBondContact O-N 3.19Å; A75-L78 PolarHBondContact O-N 2.95Å; A75-A79 PolarHBondContact O-N 3.36Å; A75-I87 HydrophobicContact CB-CG2 3.85Å; A75-E91 HydrophobicContact CB-CB 4.21Å; A75-I92 HydrophobicContact CB-CD1 3.66Å; A75-I92 HydrophobicContact CB-CG1 4.49Å; A75-A95 HydrophobicContact CB-CB 4.07Å
76	S	97.8	Very high	97.2	Very high	65 Å²	65	86.2 Å²	86.2	46%	0.455	43%	0.427	S	S	.	.	H	α-helix	trans	-64.1	-43	172.8	-171.6	0	0	0	0	111.9	G72 A73 E74 L78 A79 H80	G72-S76 WeakPolarHBondContact O-CB 3.32Å; G72-S76 PolarHBondContact O-N 3.45Å; A73-S76 PolarHBondContact O-N 3.1Å; E74-S76 VanDerWaalsContact C-N 3.29Å; E74-S76 PolarHBondContact O-N 3.42Å; S76-L78 VanDerWaalsContact C-N 3.35Å; S76-A79 PolarHBondContact O-N 3.07Å; S76-H80 PolarHBondContact O-N 3.06Å
77	R	97.9	Very high	97.2	Very high	133 Å²	133	86.6 Å²	86.6	50%	0.502	43%	0.428	S	S	.	.	H	α-helix	trans	-60.9	-44.5	174.6	-73	-169	-72.6	-177.1	-9.8	111.5	A73 E74 A79 H80 Y81	A73-R77 WeakPolarHBondContact O-CG 3.41Å; A73-R77 PolarHBondContact O-N 3.49Å; E74-R77 WeakPolarHBondContact O-CB 3.42Å; E74-R77 PolarHBondContact O-N 3.05Å; E74-R77 VanDerWaalsContact O-N 3.16Å; E74-R77 IonicContact OE2-CZ 3.13Å; E74-R77 IonicContact OE2-NE 3.24Å; E74-R77 PolarHBondContact OE2-NE 2.94Å; E74-R77 IonicContact OE2-NH2 3.37Å; E74-R77 PolarHBondContact OE2-NH2 3.49Å; R77-A79 PolarHBondContact O-N 3.07Å; R77-H80 WeakPolarHBondContact O-CB 3.47Å; R77-H80 PolarHBondContact O-N 3.5Å; R77-Y81 HydrophobicContact CB-CE2 4.38Å; R77-Y81 WeakPolarHBondContact O-CD2 3.33Å; R77-Y81 PolarHBondContact O-N 3.3Å
78	L	98	Very high	97.1	Very high	25 Å²	25	86.3 Å²	86.3	13%	0.131	43%	0.428	C	S	.	.	H	α-helix	trans	-62.8	-40.9	176.8	-69.5	169.1	0	0	0	112.5	E74 A75 S76 H80 Y81 N82 E91 T94 A95 L98	E74-L78 HydrophobicContact CG-CD1 4.31Å; E74-L78 WeakPolarHBondContact O-CG 3.35Å; E74-L78 PolarHBondContact O-N 3.33Å; A75-L78 PolarHBondContact O-N 2.95Å; S76-L78 VanDerWaalsContact C-N 3.35Å; L78-H80 VanDerWaalsContact C-N 3.33Å; L78-Y81 PolarHBondContact O-N 3.33Å; L78-N82 PolarHBondContact O-N 2.88Å; L78-N82 PolarHBondContact O-ND2 2.9Å; L78-E91 HydrophobicContact CB-CB 4.15Å; L78-E91 HydrophobicContact CB-CG 3.87Å; L78-E91 WeakPolarHBondContact CD1-O 3.47Å; L78-T94 HydrophobicContact CD1-CG2 3.71Å; L78-T94 HydrophobicContact CD2-CG2 4.18Å; L78-A95 HydrophobicContact CD1-CB 4.13Å; L78-L98 HydrophobicContact CD1-CD1 4.24Å; L78-L98 HydrophobicContact CD2-CD1 4.2Å
79	A	97.8	Very high	96.9	Very high	4 Å²	4	84.5 Å²	84.5	3%	0.033	43%	0.431	C	S	.	.	H	α-helix	trans	-63.1	-42.6	175.5	0	0	0	0	0	111.2	A75 S76 R77 N82 N83 R84 I87 E91	A75-A79 PolarHBondContact O-N 3.36Å; S76-A79 PolarHBondContact O-N 3.07Å; R77-A79 PolarHBondContact O-N 3.07Å; A79-N82 CarbonylContact O-C 3.57Å; A79-N82 PolarHBondContact O-N 3.1Å; A79-N83 PolarHBondContact O-N 3.02Å; A79-R84 PolarHBondContact O-N 2.93Å; A79-I87 HydrophobicContact CB-CG1 3.95Å; A79-E91 HydrophobicContact CB-CG 4.25Å
80	H	97.1	Very high	96.7	Very high	140 Å²	140	86.4 Å²	86.4	65%	0.648	43%	0.43	S	S	*	.	H	α-helix	trans	-61.9	-46.4	176.8	-172.5	64.1	0	0	0	112.3	S76 R77 L78 N82 N83	S76-H80 PolarHBondContact O-N 3.06Å; R77-H80 WeakPolarHBondContact O-CB 3.47Å; R77-H80 PolarHBondContact O-N 3.5Å; L78-H80 VanDerWaalsContact C-N 3.33Å; H80-N82 PolarHBondContact O-N 3.42Å; H80-N83 PolarHBondContact O-N 3.37Å
81	Y	96.9	Very high	96.6	Very high	165 Å²	165	79.9 Å²	79.9	65%	0.647	41%	0.406	S	S	*	.	H	α-helix	trans	-61.1	-28.5	176.1	-67.1	-35.1	0	0	0	113.7	R77 L78 N83	R77-Y81 HydrophobicContact CB-CE2 4.38Å; R77-Y81 WeakPolarHBondContact O-CD2 3.33Å; R77-Y81 PolarHBondContact O-N 3.3Å; L78-Y81 PolarHBondContact O-N 3.33Å; Y81-N83 VanDerWaalsContact C-N 3.3Å
82	N	96.2	Very high	96.5	Very high	75 Å²	75	81.7 Å²	81.7	40%	0.401	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.9	9.4	176.4	-69.5	-62.9	0	0	0	113.4	L78 A79 H80 R84	L78-N82 PolarHBondContact O-N 2.88Å; L78-N82 PolarHBondContact O-ND2 2.9Å; A79-N82 CarbonylContact O-C 3.57Å; A79-N82 PolarHBondContact O-N 3.1Å; H80-N82 PolarHBondContact O-N 3.42Å; N82-R84 HydrophobicContact CB-CG 4.24Å; N82-R84 PolarHBondContact O-N 2.9Å
83	N	96.4	Very high	96.4	Very high	145 Å²	145	83.3 Å²	83.3	78%	0.775	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	38.6	-174.6	-59.7	-61.4	0	0	0	113	A79 H80 Y81	A79-N83 PolarHBondContact O-N 3.02Å; H80-N83 PolarHBondContact O-N 3.37Å; Y81-N83 VanDerWaalsContact C-N 3.3Å
84	R	96.3	Very high	96.3	Very high	133 Å²	133	82.9 Å²	82.9	50%	0.502	41%	0.406	S	S	.	.			trans	-109.6	140.9	178.2	-67.1	-172.4	174.3	-167.7	-5.1	110.6	A79 N82	A79-R84 PolarHBondContact O-N 2.93Å; N82-R84 HydrophobicContact CB-CG 4.24Å; N82-R84 PolarHBondContact O-N 2.9Å
85	H	95.4	Very high	96.3	Very high	198 Å²	198	81.8 Å²	81.8	92%	0.917	40%	0.401	S	S	*	.	S	Bend	trans	-92	-3.3	172.9	-59.5	-69.1	0	0	0	113.3
86	T	96.9	Very high	96.2	Very high	106 Å²	106	82.7 Å²	82.7	65%	0.65	41%	0.406	S	S	*	.	S	Bend	trans	-125.3	124.9	-177.3	-52	0	0	0	0	109.8
87	I	96.7	Very high	96.2	Very high	75 Å²	75	85.3 Å²	85.3	39%	0.385	41%	0.407	S	S	.	.			trans	-77.1	119.2	171.7	-60.2	173.9	0	0	0	108.2	A75 A79 E91 I92	A75-I87 HydrophobicContact CB-CG2 3.85Å; A79-I87 HydrophobicContact CB-CG1 3.95Å; I87-E91 HydrophobicContact CG2-CB 4.03Å; I87-I92 HydrophobicContact CG2-CD1 3.78Å; I87-I92 HydrophobicContact CG2-CG1 3.96Å
88	S	93.8	Very high	96.1	Very high	38 Å²	38	84 Å²	84	27%	0.266	41%	0.409	S	S	.	.			trans	-97.7	173.5	175.1	81.9	0	0	0	0	111.5	R90 E91 I92	S88-R90 PolarHBondContact O-N 2.97Å; S88-R90 VanDerWaalsContact O-N 3.14Å; S88-R90 WeakPolarHBondContact OG-CB 3.33Å; S88-R90 PolarHBondContact OG-N 3.34Å; S88-E91 VanDerWaalsContact CA-OE2 3.29Å; S88-E91 WeakPolarHBondContact CA-OE2 3.38Å; S88-E91 WeakPolarHBondContact CB-OE2 3.48Å; S88-E91 PolarHBondContact N-OE2 3.41Å; S88-E91 PolarHBondContact O-N 3.2Å; S88-E91 PolarHBondContact OG-OE2 3.14Å; S88-I92 PolarHBondContact O-N 2.75Å
89	S	91.7	Very high	96.1	Very high	88 Å²	88	85.9 Å²	85.9	62%	0.615	42%	0.419	S	S	*	.	H	α-helix	trans	-57	-27	173.1	55.8	0	0	0	0	112.6	Q93	S89-Q93 WeakPolarHBondContact O-CB 3.4Å; S89-Q93 VanDerWaalsContact O-CG 3.26Å; S89-Q93 WeakPolarHBondContact O-CG 3.39Å; S89-Q93 PolarHBondContact O-N 3Å
90	R	93	Very high	96	Very high	146 Å²	146	87.5 Å²	87.5	55%	0.551	43%	0.426	S	S	*	.	H	α-helix	trans	-66	-47.3	177.3	-174.2	176.4	-179.6	-107.2	3.7	111.8	S88 I92 Q93 T94	S88-R90 PolarHBondContact O-N 2.97Å; S88-R90 VanDerWaalsContact O-N 3.14Å; S88-R90 WeakPolarHBondContact OG-CB 3.33Å; S88-R90 PolarHBondContact OG-N 3.34Å; R90-I92 VanDerWaalsContact C-N 3.32Å; R90-I92 PolarHBondContact O-N 3.37Å; R90-Q93 PolarHBondContact O-N 3.4Å; R90-T94 WeakPolarHBondContact O-CB 3.46Å; R90-T94 PolarHBondContact O-N 3.43Å; R90-T94 PolarHBondContact O-OG1 3.05Å; R90-T94 VanDerWaalsContact O-OG1 3.07Å
91	E	95.6	Very high	96	Very high	3 Å²	3	85.6 Å²	85.6	1%	0.014	43%	0.427	C	S	.	.	H	α-helix	trans	-64	-39.9	178.1	-71.8	73.1	-144.1	0	0	110.9	A75 L78 A79 I87 S88 T94 A95	A75-E91 HydrophobicContact CB-CB 4.21Å; L78-E91 HydrophobicContact CB-CB 4.15Å; L78-E91 HydrophobicContact CB-CG 3.87Å; L78-E91 WeakPolarHBondContact CD1-O 3.47Å; A79-E91 HydrophobicContact CB-CG 4.25Å; I87-E91 HydrophobicContact CG2-CB 4.03Å; S88-E91 VanDerWaalsContact CA-OE2 3.29Å; S88-E91 WeakPolarHBondContact CA-OE2 3.38Å; S88-E91 WeakPolarHBondContact CB-OE2 3.48Å; S88-E91 PolarHBondContact N-OE2 3.41Å; S88-E91 PolarHBondContact O-N 3.2Å; S88-E91 PolarHBondContact OG-OE2 3.14Å; E91-T94 PolarHBondContact O-N 3.32Å; E91-A95 VanDerWaalsContact O-CB 3.24Å; E91-A95 WeakPolarHBondContact O-CB 3.38Å; E91-A95 PolarHBondContact O-N 3.4Å
92	I	96.3	Very high	95.9	Very high	69 Å²	69	80.3 Å²	80.3	35%	0.354	42%	0.423	S	S	.	.	H	α-helix	trans	-61.8	-48.3	175.4	-58.9	-68.1	0	0	0	111.2	I71 A75 I87 S88 R90 T94 A95 V96	I71-I92 HydrophobicContact CG2-CG2 4.29Å; A75-I92 HydrophobicContact CB-CD1 3.66Å; A75-I92 HydrophobicContact CB-CG1 4.49Å; I87-I92 HydrophobicContact CG2-CD1 3.78Å; I87-I92 HydrophobicContact CG2-CG1 3.96Å; S88-I92 PolarHBondContact O-N 2.75Å; R90-I92 VanDerWaalsContact C-N 3.32Å; R90-I92 PolarHBondContact O-N 3.37Å; I92-T94 PolarHBondContact O-N 3.22Å; I92-A95 WeakPolarHBondContact O-CB 3.42Å; I92-A95 PolarHBondContact O-N 2.91Å; I92-V96 WeakPolarHBondContact O-CG2 3.43Å; I92-V96 PolarHBondContact O-N 2.87Å
93	Q	95.3	Very high	95.9	Very high	64 Å²	64	81.9 Å²	81.9	30%	0.299	43%	0.427	S	S	.	.	H	α-helix	trans	-64	-39.7	179.3	-73.7	177.8	12.7	0	0	112.4	S89 R90 V96 R97	S89-Q93 WeakPolarHBondContact O-CB 3.4Å; S89-Q93 VanDerWaalsContact O-CG 3.26Å; S89-Q93 WeakPolarHBondContact O-CG 3.39Å; S89-Q93 PolarHBondContact O-N 3Å; R90-Q93 PolarHBondContact O-N 3.4Å; Q93-V96 PolarHBondContact O-N 3.23Å; Q93-R97 WeakPolarHBondContact O-CG 3.36Å; Q93-R97 PolarHBondContact O-N 3.47Å
94	T	96.6	Very high	95.9	Very high	45 Å²	45	79.6 Å²	79.6	28%	0.276	42%	0.415	S	S	.	.	H	α-helix	trans	-67.6	-42.2	176.2	-60.2	0	0	0	0	111.1	L78 R90 E91 I92 V96 R97 L98	L78-T94 HydrophobicContact CD1-CG2 3.71Å; L78-T94 HydrophobicContact CD2-CG2 4.18Å; R90-T94 WeakPolarHBondContact O-CB 3.46Å; R90-T94 PolarHBondContact O-N 3.43Å; R90-T94 PolarHBondContact O-OG1 3.05Å; R90-T94 VanDerWaalsContact O-OG1 3.07Å; E91-T94 PolarHBondContact O-N 3.32Å; I92-T94 PolarHBondContact O-N 3.22Å; T94-V96 VanDerWaalsContact C-N 3.3Å; T94-V96 PolarHBondContact O-N 2.99Å; T94-R97 WeakPolarHBondContact O-CB 3.36Å; T94-R97 PolarHBondContact O-N 2.88Å; T94-L98 HydrophobicContact CG2-CD1 4.23Å; T94-L98 HydrophobicContact CG2-CG 4.48Å; T94-L98 WeakPolarHBondContact O-CG 3.39Å; T94-L98 PolarHBondContact O-N 3.34Å
95	A	97.6	Very high	95.9	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-55.9	-44.7	174.2	0	0	0	0	0	112.2	I71 E74 A75 L78 E91 I92 R97 L98 L99	I71-A95 HydrophobicContact CG2-CB 4.23Å; E74-A95 HydrophobicContact CB-CB 3.7Å; E74-A95 HydrophobicContact CG-CB 3.65Å; A75-A95 HydrophobicContact CB-CB 4.07Å; L78-A95 HydrophobicContact CD1-CB 4.13Å; E91-A95 VanDerWaalsContact O-CB 3.24Å; E91-A95 WeakPolarHBondContact O-CB 3.38Å; E91-A95 PolarHBondContact O-N 3.4Å; I92-A95 WeakPolarHBondContact O-CB 3.42Å; I92-A95 PolarHBondContact O-N 2.91Å; A95-R97 VanDerWaalsContact C-N 3.31Å; A95-R97 PolarHBondContact O-N 3.45Å; A95-L98 PolarHBondContact O-N 2.9Å; A95-L98 VanDerWaalsContact O-N 3.16Å; A95-L99 WeakPolarHBondContact O-CG 3.31Å; A95-L99 PolarHBondContact O-N 2.99Å
96	V	97.6	Very high	95.9	Very high	19 Å²	19	70.9 Å²	70.9	12%	0.115	38%	0.38	C	S	.	.	H	α-helix	trans	-59.5	-41.6	175.3	170.8	0	0	0	0	111.6	I71 I92 Q93 T94 L98 L99 L100 A108 V109	I71-V96 HydrophobicContact CD1-CG2 3.98Å; I71-V96 HydrophobicContact CG1-CG2 4.28Å; I71-V96 HydrophobicContact CG2-CG2 4.26Å; I92-V96 WeakPolarHBondContact O-CG2 3.43Å; I92-V96 PolarHBondContact O-N 2.87Å; Q93-V96 PolarHBondContact O-N 3.23Å; T94-V96 VanDerWaalsContact C-N 3.3Å; T94-V96 PolarHBondContact O-N 2.99Å; V96-L98 VanDerWaalsContact C-N 3.31Å; V96-L98 PolarHBondContact O-N 3.05Å; V96-L99 PolarHBondContact O-N 3.47Å; V96-L100 HydrophobicContact CG1-CD1 3.83Å; V96-L100 HydrophobicContact CG1-CG 4.46Å; V96-L100 WeakPolarHBondContact O-CB 3.41Å; V96-L100 PolarHBondContact O-N 3.4Å; V96-A108 HydrophobicContact CG1-CB 3.61Å; V96-V109 HydrophobicContact CB-CG2 4.47Å; V96-V109 HydrophobicContact CG1-CG2 4.04Å
97	R	96.5	Very high	95.9	Very high	121 Å²	121	71.2 Å²	71.2	46%	0.457	37%	0.374	S	S	.	.	H	α-helix	trans	-67.4	-30.1	177	-68.4	179.3	-174.9	105.3	-6.7	113.4	Q93 T94 A95 V109	Q93-R97 WeakPolarHBondContact O-CG 3.36Å; Q93-R97 PolarHBondContact O-N 3.47Å; T94-R97 WeakPolarHBondContact O-CB 3.36Å; T94-R97 PolarHBondContact O-N 2.88Å; A95-R97 VanDerWaalsContact C-N 3.31Å; A95-R97 PolarHBondContact O-N 3.45Å; R97-V109 HydrophobicContact CG-CG2 3.88Å
98	L	97.2	Very high	95.8	Very high	106 Å²	106	69.3 Å²	69.3	56%	0.555	37%	0.37	S	S	*	.	H	α-helix	trans	-77.8	-35.3	177.7	-68.3	173.5	0	0	0	112.3	E74 L78 T94 A95 V96	E74-L98 HydrophobicContact CG-CB 4.38Å; E74-L98 HydrophobicContact CG-CD1 4.01Å; E74-L98 VanDerWaalsContact OE1-CD1 3.24Å; E74-L98 WeakPolarHBondContact OE1-CD1 3.41Å; L78-L98 HydrophobicContact CD1-CD1 4.24Å; L78-L98 HydrophobicContact CD2-CD1 4.2Å; T94-L98 HydrophobicContact CG2-CD1 4.23Å; T94-L98 HydrophobicContact CG2-CG 4.48Å; T94-L98 WeakPolarHBondContact O-CG 3.39Å; T94-L98 PolarHBondContact O-N 3.34Å; A95-L98 PolarHBondContact O-N 2.9Å; A95-L98 VanDerWaalsContact O-N 3.16Å; V96-L98 VanDerWaalsContact C-N 3.31Å; V96-L98 PolarHBondContact O-N 3.05Å
99	L	97.2	Very high	95.9	Very high	63 Å²	63	68.3 Å²	68.3	33%	0.33	36%	0.362	S	S	.	.	H	α-helix	trans	-86.1	-31.1	-175.6	-69.3	168.4	0	0	0	113.8	R70 I71 E74 A95 V96	R70-L99 VanDerWaalsContact C-CD1 3.48Å; R70-L99 HydrophobicContact CB-CD1 3.94Å; R70-L99 HydrophobicContact CB-CD2 4.22Å; I71-L99 VanDerWaalsContact CA-CD1 3.48Å; I71-L99 HydrophobicContact CB-CD1 4.15Å; I71-L99 HydrophobicContact CG1-CD1 3.57Å; E74-L99 HydrophobicContact CB-CD1 4.16Å; A95-L99 WeakPolarHBondContact O-CG 3.31Å; A95-L99 PolarHBondContact O-N 2.99Å; V96-L99 PolarHBondContact O-N 3.47Å
100	L	96	Very high	96	Very high	38 Å²	38	66.7 Å²	66.7	20%	0.199	35%	0.35	C	S	.	.	S	Bend	trans	-105.2	129.8	-175.5	-55.7	-177.8	0	0	0	110.7	V96 L104 S105 A108	V96-L100 HydrophobicContact CG1-CD1 3.83Å; V96-L100 HydrophobicContact CG1-CG 4.46Å; V96-L100 WeakPolarHBondContact O-CB 3.41Å; V96-L100 PolarHBondContact O-N 3.4Å; L100-L104 HydrophobicContact CB-CB 4.3Å; L100-L104 HydrophobicContact CB-CD2 4.13Å; L100-L104 HydrophobicContact CB-CG 4.05Å; L100-L104 HydrophobicContact CD1-CD2 4.4Å; L100-L104 HydrophobicContact CD1-CG 4.07Å; L100-L104 HydrophobicContact CD2-CD2 3.88Å; L100-L104 HydrophobicContact CD2-CG 4.43Å; L100-L104 HydrophobicContact CG-CD2 4.35Å; L100-L104 HydrophobicContact CG-CG 4.41Å; L100-S105 WeakPolarHBondContact O-CB 3.46Å; L100-A108 HydrophobicContact CD1-CB 3.65Å
101	P	96.1	Very high	96.1	Very high	101 Å²	101	64.6 Å²	64.6	66%	0.656	35%	0.347	S	S	*	.			trans	-80.3	150.1	-178.7	30.9	-35.1	0	0	0	113	E103 L104	P101-E103 PolarHBondContact O-N 3.16Å; P101-L104 VanDerWaalsContact O-CB 3.32Å; P101-L104 WeakPolarHBondContact O-CB 3.5Å; P101-L104 PolarHBondContact O-N 3.47Å; P101-L104 VanDerWaalsContact O-N 3.13Å
102	G	95.5	Very high	96	Very high	54 Å²	54	66.1 Å²	66.1	56%	0.557	36%	0.364	S	S	*	.	H	α-helix	trans	52.2	-131.2	163.2	0	0	0	0	0	114.8	L104 S105	G102-L104 PolarHBondContact O-N 3.17Å; G102-S105 PolarHBondContact O-N 2.98Å; G102-S105 PolarHBondContact O-OG 2.95Å
103	E	96.1	Very high	95.8	Very high	108 Å²	108	65.9 Å²	65.9	51%	0.505	37%	0.366	S	S	.	.	H	α-helix	trans	-59.1	-31	-179.4	-68	-55.7	123.4	0	0	113	P101 S105 K106 H107	P101-E103 PolarHBondContact O-N 3.16Å; E103-S105 VanDerWaalsContact C-N 3.28Å; E103-S105 PolarHBondContact O-N 3.37Å; E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 PolarHBondContact O-N 3.47Å; E103-K106 VanDerWaalsContact O-N 3.08Å; E103-K106 WeakPolarHBondContact OE1-CE 3.15Å; E103-K106 IonicContact OE1-NZ 2.71Å; E103-K106 PolarHBondContact OE1-NZ 2.98Å; E103-H107 PolarHBondContact O-CD2 3.1Å; E103-H107 PolarHBondContact O-N 2.92Å
104	L	96.1	Very high	95.7	Very high	97 Å²	97	68.4 Å²	68.4	51%	0.508	38%	0.375	S	S	.	.	H	α-helix	trans	-61.4	-38.5	-179.4	-171.4	61.9	0	0	0	111.6	L100 P101 G102 A108	L100-L104 HydrophobicContact CB-CB 4.3Å; L100-L104 HydrophobicContact CB-CD2 4.13Å; L100-L104 HydrophobicContact CB-CG 4.05Å; L100-L104 HydrophobicContact CD1-CD2 4.4Å; L100-L104 HydrophobicContact CD1-CG 4.07Å; L100-L104 HydrophobicContact CD2-CD2 3.88Å; L100-L104 HydrophobicContact CD2-CG 4.43Å; L100-L104 HydrophobicContact CG-CD2 4.35Å; L100-L104 HydrophobicContact CG-CG 4.41Å; P101-L104 VanDerWaalsContact O-CB 3.32Å; P101-L104 WeakPolarHBondContact O-CB 3.5Å; P101-L104 PolarHBondContact O-N 3.47Å; P101-L104 VanDerWaalsContact O-N 3.13Å; G102-L104 PolarHBondContact O-N 3.17Å; L104-A108 VanDerWaalsContact O-CB 3.25Å; L104-A108 WeakPolarHBondContact O-CB 3.38Å; L104-A108 PolarHBondContact O-N 3.36Å
105	S	96	Very high	95.4	Very high	19 Å²	19	69 Å²	69	13%	0.133	39%	0.385	C	S	.	.	H	α-helix	trans	-64.1	-42.2	174.5	70.1	0	0	0	0	112.5	L100 G102 E103 A108 V109	L100-S105 WeakPolarHBondContact O-CB 3.46Å; G102-S105 PolarHBondContact O-N 2.98Å; G102-S105 PolarHBondContact O-OG 2.95Å; E103-S105 VanDerWaalsContact C-N 3.28Å; E103-S105 PolarHBondContact O-N 3.37Å; S105-A108 PolarHBondContact O-N 3.46Å; S105-V109 WeakPolarHBondContact O-CB 3.25Å; S105-V109 VanDerWaalsContact O-CG2 3.31Å; S105-V109 WeakPolarHBondContact O-CG2 3.32Å; S105-V109 PolarHBondContact O-N 3.02Å
106	K	95.8	Very high	95	Very high	128 Å²	128	73.4 Å²	73.4	56%	0.557	41%	0.412	S	S	*	.	H	α-helix	trans	-64.5	-47.2	-179	-62.6	-179.8	-174.1	167.8	0	110.4	E103 S110	E103-K106 WeakPolarHBondContact O-CB 3.47Å; E103-K106 PolarHBondContact O-N 3.47Å; E103-K106 VanDerWaalsContact O-N 3.08Å; E103-K106 WeakPolarHBondContact OE1-CE 3.15Å; E103-K106 IonicContact OE1-NZ 2.71Å; E103-K106 PolarHBondContact OE1-NZ 2.98Å; K106-S110 VanDerWaalsContact O-CB 3.23Å; K106-S110 WeakPolarHBondContact O-CB 3.34Å; K106-S110 PolarHBondContact O-N 2.92Å
107	H	96.4	Very high	94.7	Very high	113 Å²	113	76.4 Å²	76.4	52%	0.523	43%	0.43	S	S	.	.	H	α-helix	trans	-62.3	-48.9	176.1	-73.6	-71.1	0	0	0	111.6	E103 V109 S110 E111	E103-H107 PolarHBondContact O-CD2 3.1Å; E103-H107 PolarHBondContact O-N 2.92Å; H107-V109 PolarHBondContact O-N 3.49Å; H107-S110 PolarHBondContact O-N 3.01Å; H107-E111 WeakPolarHBondContact O-CB 3.44Å; H107-E111 WeakPolarHBondContact O-CG 3.35Å; H107-E111 PolarHBondContact O-N 3.39Å
108	A	95.9	Very high	94.6	Very high	36 Å²	36	78.5 Å²	78.5	30%	0.298	44%	0.443	S	S	.	.	H	α-helix	trans	-60.7	-43.5	-178.2	0	0	0	0	0	112.7	V96 L100 L104 S105 G112	V96-A108 HydrophobicContact CG1-CB 3.61Å; L100-A108 HydrophobicContact CD1-CB 3.65Å; L104-A108 VanDerWaalsContact O-CB 3.25Å; L104-A108 WeakPolarHBondContact O-CB 3.38Å; L104-A108 PolarHBondContact O-N 3.36Å; S105-A108 PolarHBondContact O-N 3.46Å; A108-G112 PolarHBondContact O-N 3.34Å
109	V	95.1	Very high	94.3	Very high	17 Å²	17	82.5 Å²	82.5	10%	0.103	45%	0.452	C	S	.	.	H	α-helix	trans	-68.4	-41.4	177	172.7	0	0	0	0	111.6	V96 R97 S105 H107 G112 T113	V96-V109 HydrophobicContact CB-CG2 4.47Å; V96-V109 HydrophobicContact CG1-CG2 4.04Å; R97-V109 HydrophobicContact CG-CG2 3.88Å; S105-V109 WeakPolarHBondContact O-CB 3.25Å; S105-V109 VanDerWaalsContact O-CG2 3.31Å; S105-V109 WeakPolarHBondContact O-CG2 3.32Å; S105-V109 PolarHBondContact O-N 3.02Å; H107-V109 PolarHBondContact O-N 3.49Å; V109-G112 PolarHBondContact O-N 2.8Å; V109-T113 WeakPolarHBondContact O-CB 3.4Å; V109-T113 PolarHBondContact O-N 3.14Å; V109-T113 PolarHBondContact O-OG1 2.95Å
110	S	95.2	Very high	94.1	Very high	53 Å²	53	83.8 Å²	83.8	37%	0.371	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-50.2	178	-173	0	0	0	0	111.4	K106 H107 G112 T113 K114	K106-S110 VanDerWaalsContact O-CB 3.23Å; K106-S110 WeakPolarHBondContact O-CB 3.34Å; K106-S110 PolarHBondContact O-N 2.92Å; H107-S110 PolarHBondContact O-N 3.01Å; S110-G112 PolarHBondContact O-N 2.97Å; S110-T113 PolarHBondContact O-N 3.48Å; S110-K114 WeakPolarHBondContact O-CG 3.36Å; S110-K114 PolarHBondContact O-N 2.72Å
111	E	94.5	Very high	94	Very high	102 Å²	102	86.3 Å²	86.3	48%	0.477	48%	0.483	S	S	.	.	H	α-helix	trans	-64.2	-40.5	177.8	-68.5	-52.9	126.5	0	0	111.9	H107 T113 K114 A115	H107-E111 WeakPolarHBondContact O-CB 3.44Å; H107-E111 WeakPolarHBondContact O-CG 3.35Å; H107-E111 PolarHBondContact O-N 3.39Å; E111-T113 VanDerWaalsContact C-N 3.33Å; E111-T113 PolarHBondContact O-N 3.42Å; E111-K114 PolarHBondContact O-N 3.24Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.26Å; E111-A115 WeakPolarHBondContact O-CB 3.23Å; E111-A115 PolarHBondContact O-N 3.3Å
112	G	93.2	Very high	93.8	Very high	36 Å²	36	85.7 Å²	85.7	37%	0.371	49%	0.486	S	S	.	.	H	α-helix	trans	-59.3	-43	174.3	0	0	0	0	0	112.5	A108 V109 S110 A115 V116	A108-G112 PolarHBondContact O-N 3.34Å; V109-G112 PolarHBondContact O-N 2.8Å; S110-G112 PolarHBondContact O-N 2.97Å; G112-A115 PolarHBondContact O-N 3.45Å; G112-V116 WeakPolarHBondContact O-CG2 3.49Å; G112-V116 PolarHBondContact O-N 3.24Å
113	T	92.2	Very high	92.3	Very high	64 Å²	64	95 Å²	95	39%	0.393	51%	0.511	S	S	.	.	H	α-helix	trans	-66.3	-44.2	178.4	-54.1	0	0	0	0	111.4	V109 S110 E111 A115 V116 T117	V109-T113 WeakPolarHBondContact O-CB 3.4Å; V109-T113 PolarHBondContact O-N 3.14Å; V109-T113 PolarHBondContact O-OG1 2.95Å; S110-T113 PolarHBondContact O-N 3.48Å; E111-T113 VanDerWaalsContact C-N 3.33Å; E111-T113 PolarHBondContact O-N 3.42Å; T113-A115 VanDerWaalsContact C-N 3.3Å; T113-A115 PolarHBondContact O-N 2.85Å; T113-V116 PolarHBondContact O-N 2.94Å; T113-T117 PolarHBondContact O-N 3.37Å; T113-T117 PolarHBondContact O-OG1 3.25Å
114	K	92.9	Very high	92.1	Very high	116 Å²	116	94.3 Å²	94.3	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-59.6	-41.9	174.1	-67.8	172.8	-167.1	169.1	0	111.7	S110 E111 V116 T117 K118	S110-K114 WeakPolarHBondContact O-CG 3.36Å; S110-K114 PolarHBondContact O-N 2.72Å; E111-K114 PolarHBondContact O-N 3.24Å; E111-K114 IonicContact OE1-NZ 2.74Å; E111-K114 PolarHBondContact OE1-NZ 3.26Å; K114-V116 PolarHBondContact O-N 2.98Å; K114-T117 PolarHBondContact O-N 3.15Å; K114-K118 PolarHBondContact O-N 3.4Å
115	A	90.9	Very high	91.9	Very high	58 Å²	58	94.2 Å²	94.2	48%	0.479	51%	0.512	S	S	.	.	H	α-helix	trans	-63.6	-40	179.5	0	0	0	0	0	112.1	E111 G112 T113 K118 Y119	E111-A115 WeakPolarHBondContact O-CB 3.23Å; E111-A115 PolarHBondContact O-N 3.3Å; G112-A115 PolarHBondContact O-N 3.45Å; T113-A115 VanDerWaalsContact C-N 3.3Å; T113-A115 PolarHBondContact O-N 2.85Å; A115-K118 PolarHBondContact O-N 2.76Å; A115-Y119 WeakPolarHBondContact O-CB 3.45Å; A115-Y119 PolarHBondContact O-N 3.24Å
116	V	89.8	Confident	91.6	Very high	93 Å²	93	98.3 Å²	98.3	56%	0.564	53%	0.533	S	S	*	.	H	α-helix	trans	-60.9	-48.5	174.9	172	0	0	0	0	110.7	G112 T113 K114 K118 Y119 T120	G112-V116 WeakPolarHBondContact O-CG2 3.49Å; G112-V116 PolarHBondContact O-N 3.24Å; T113-V116 PolarHBondContact O-N 2.94Å; K114-V116 PolarHBondContact O-N 2.98Å; V116-K118 PolarHBondContact O-N 3.08Å; V116-Y119 WeakPolarHBondContact O-CB 3.49Å; V116-Y119 PolarHBondContact O-N 2.75Å; V116-T120 PolarHBondContact O-N 3.25Å; V116-T120 PolarHBondContact O-OG1 3.44Å
117	T	91.3	Very high	91.4	Very high	82 Å²	82	96.6 Å²	96.6	50%	0.503	53%	0.532	S	S	.	.	H	α-helix	trans	-58.3	-48.1	177.3	-55.5	0	0	0	0	111.6	T113 K114 Y119 T120 S121	T113-T117 PolarHBondContact O-N 3.37Å; T113-T117 PolarHBondContact O-OG1 3.25Å; K114-T117 PolarHBondContact O-N 3.15Å; T117-Y119 VanDerWaalsContact C-N 3.3Å; T117-Y119 PolarHBondContact O-N 3.13Å; T117-T120 WeakPolarHBondContact CA-OG1 3.47Å; T117-T120 PolarHBondContact O-N 3.13Å; T117-T120 PolarHBondContact O-OG1 2.81Å; T117-S121 PolarHBondContact O-N 3.23Å; T117-S121 PolarHBondContact O-OG 2.71Å
118	K	93.2	Very high	91.1	Very high	165 Å²	165	95.6 Å²	95.6	72%	0.717	53%	0.532	S	S	*	.	H	α-helix	trans	-59.8	-41.6	177.7	-177.4	176.6	-179.3	175.2	0	112	K114 A115 V116 S121 A122	K114-K118 PolarHBondContact O-N 3.4Å; A115-K118 PolarHBondContact O-N 2.76Å; V116-K118 PolarHBondContact O-N 3.08Å; K118-S121 PolarHBondContact O-N 3.08Å; K118-A122 WeakPolarHBondContact O-CB 3.49Å; K118-A122 PolarHBondContact O-N 3.24Å; K118-A122 VanDerWaalsContact O-N 3.15Å
119	Y	90.8	Very high	90.8	Very high	190 Å²	190	99.5 Å²	99.5	75%	0.745	55%	0.548	S	S	*	.	H	α-helix	trans	-63.5	-42.3	178.4	-178.3	-99.1	0	0	0	111.6	A115 V116 T117 S121	A115-Y119 WeakPolarHBondContact O-CB 3.45Å; A115-Y119 PolarHBondContact O-N 3.24Å; V116-Y119 WeakPolarHBondContact O-CB 3.49Å; V116-Y119 PolarHBondContact O-N 2.75Å; T117-Y119 VanDerWaalsContact C-N 3.3Å; T117-Y119 PolarHBondContact O-N 3.13Å; Y119-S121 VanDerWaalsContact C-N 3.35Å; Y119-S121 PolarHBondContact O-N 2.74Å
120	T	93	Very high	90.4	Very high	90 Å²	90	105.4 Å²	105.4	55%	0.552	58%	0.58	S	S	*	*	H	α-helix	trans	-67.7	-32.4	178	50.8	0	0	0	0	113.4	V116 T117	V116-T120 PolarHBondContact O-N 3.25Å; V116-T120 PolarHBondContact O-OG1 3.44Å; T117-T120 WeakPolarHBondContact CA-OG1 3.47Å; T117-T120 PolarHBondContact O-N 3.13Å; T117-T120 PolarHBondContact O-OG1 2.81Å
121	S	94.3	Very high	90.1	Very high	91 Å²	91	109.5 Å²	109.5	64%	0.636	60%	0.596	S	S	*	*	H	α-helix	trans	-83.8	-16.3	179.9	-55.8	0	0	0	0	114.6	T117 K118 Y119 K123	T117-S121 PolarHBondContact O-N 3.23Å; T117-S121 PolarHBondContact O-OG 2.71Å; K118-S121 PolarHBondContact O-N 3.08Å; Y119-S121 VanDerWaalsContact C-N 3.35Å; Y119-S121 PolarHBondContact O-N 2.74Å; S121-K123 VanDerWaalsContact C-N 3.3Å
122	A	91	Very high	89.7	Confident	87 Å²	87	110.1 Å²	110.1	72%	0.719	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.4	2.6	-176.2	0	0	0	0	0	114.1	K118	K118-A122 WeakPolarHBondContact O-CB 3.49Å; K118-A122 PolarHBondContact O-N 3.24Å; K118-A122 VanDerWaalsContact O-N 3.15Å
123	K	64.2	Low	89.4	Confident	249 Å²	249	116.8 Å²	116.8	100%	1.083	63%	0.627	S	S	*	*			trans	-107.6	0	179.1	-168.7	-177.5	-177.8	-176.6	0	110.3	S121	S121-K123 VanDerWaalsContact C-N 3.3Å

Retrieved 123 of 123 residues in 21 ms (Link to these results)

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